Dup-105 - Moligand™, ≥98% , CAS No.96800-41-8

CAS: 96800-41-8 Cat. No.: D610017 Molecular Weight: 296.34 PubChem CID: 57141
AVAILABLE TO ORDER
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
Synonyms
N-[[(5S)-3-(4-methylsulfinylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide | Dup 105 | DYQQGUHGVT | DuP105 | UNII-DYQQGUHGVT
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1mg
D610017-1mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$149.90
5mg
D610017-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$742.90
10mg
D610017-10mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$731.90
25mg
D610017-25mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,199.90
Enter a quantity for the sizes you want to add.
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Why this grade

Moligand™, ≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

DuP 105 is an oxazolidinone compound that can resist gram-positive bacteria.

Specifications

Synonyms
N-[[(5S)-3-(4-methylsulfinylphenyl)-2-oxo-1, 3-oxazolidin-5-yl]methyl]acetamide | Dup 105 | DYQQGUHGVT | DuP105 | UNII-DYQQGUHGVT
Specifications & Purity
Moligand™, ≥98%
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Grade
Moligand™
Action Type
INHIBITOR
Purity
≥98%
Names and Identifiers
Canonical SmilesCC(=O)NCC1CN(C(=O)O1)C2=CC=C(C=C2)S(=O)C
IUPAC NameN-[[(5S)-3-(4-methylsulfinylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
InChIKeyRYTTWOVTZKVWTO-ZOZMEPSFSA-N
INCHI1S/C13H16N2O4S/c1-9(16)14-7-11-8-15(13(17)19-11)10-3-5-12(6-4-10)20(2)18/h3-6,11H,7-8H2,1-2H3,(H,14,16)/t11-,20?/m0/s1
Isomeric SMILES CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC=C(C=C2)S(=O)C
Alternate CAS 96800-41-8
PubChem CID 57141
MeSH Entry Terms 4-methylsulfinylphenyloxooxazolidinylmethylacetamide;DuP 105;Dup-105
Molecular Weight 296.34

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassPhenyl sulfoxides
Intermediate Tree Nodes Not available
Direct ParentPhenyl sulfoxides
Alternative Parents Oxazolidinones  Carbamate esters  Acetamides  Sulfoxides  Secondary carboxylic acid amides  Organic carbonic acids and derivatives  Sulfinyl compounds  Oxacyclic compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Phenyl sulfoxide - Oxazolidinone - Oxazolidine - Acetamide - Carbamic acid ester - Carboxamide group - Carbonic acid derivative - Sulfoxide - Secondary carboxylic acid amide - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenyl sulfoxides. These are organosulfur compounds containing a sulfoxide group substituted with a phenyl group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(non-human)
Staphylococcus aureus (210822 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mycobacterium tuberculosis (203094 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight296.340 g/mol
XLogP30.000
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass296.083 Da
Monoisotopic Mass296.083 Da
Topological Polar Surface Area94.900 Ų
Heavy Atom Count20
Formal Charge0
Complexity407.000
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
Reviews

Customer Reviews

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